N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-phenyl-propanamide

Systemtic Name: N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-phenyl-propanamide Openeye Name: N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-phenyl-propanamide CAS Name: N-[3-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]phenyl]-3-phenylpropanamide IUPAC Name: N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-phenylpropanamide Traditional Name: N-[3-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]phenyl]-3-phenyl-propionamide Formula: C25H24ClN3O2S MolecularWeight: 465.99496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

InChI

InChI=1S/C25H24ClN3O2S/c26-22-12-5-4-9-19(22)14-16-24(31)29-25(32)28-21-11-6-10-20(17-21)27-23(30)15-13-18-7-2-1-3-8-18/h1-12,17H,13-16H2,(H,27,30)(H2,28,29,31,32)